5-chloranyl-3-ethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylic acid

Systemtic Name: 5-chloranyl-3-ethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylic acid Openeye Name: 5-chloro-3-ethyl-1-(p-tolylmethyl)pyrazole-4-carboxylic acid CAS Name: 5-chloro-3-ethyl-1-[(4-methylphenyl)methyl]-4-pyrazolecarboxylic acid IUPAC Name: 5-chloro-3-ethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylic acid Traditional Name: 5-chloro-3-ethyl-1-(4-methylbenzyl)pyrazole-4-carboxylic acid Formula: C14H15ClN2O2 MolecularWeight: 278.7341

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1C(=O)O)Cl)CC2=CC=C(C=C2)C

Isomeric SMILES

CCC1=NN(C(=C1C(=O)O)Cl)CC2=CC=C(C=C2)C

InChI

InChI=1S/C14H15ClN2O2/c1-3-11-12(14(18)19)13(15)17(16-11)8-10-6-4-9(2)5-7-10/h4-7H,3,8H2,1-2H3,(H,18,19)